Ligand name: 2-methyl-2-(3-methyl-4-{[4-(methylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino}-1H-pyrazol-1-yl)propanenitrile
PDB ligand accession: TVT
DrugBank: n/a
PubChem: 69093374
ChEMBL: CHEMBL3122113
InChI Key: ZPPUMAMZIMPJGP-UHFFFAOYSA-N
SMILES: Cc1c(cn(n1)C(C)(C)C#N)Nc2ncc(c(n2)NC)C(F)(F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazines
      • Subclass: Pyrimidines and pyrimidine derivatives

List of PDB structures and/or AlphaFold models with target protein O14757

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7BJD	Download	Experimental	e7bjdA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot